| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 19 | Yes |
Popular Name: 1-{[5-(3-fluorophenyl)thien-2-yl]methyl}piperazine 1-{[5-(3-fluorophenyl)thien-2-yl…
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CAS Number: 1049872-87-8
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.00 | 6.45 | -42.66 | 2 | 2 | 1 | 20 | 277.388 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 5.03 | -4.22 | 1 | 2 | 0 | 15 | 276.38 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
